Geometry & MOs

Info

ID:	245696
PubChem CID:	103022972
Reduced:	ClSN3O3C7H12 (1)
Stoich.:	ABC3D3E7F12 (1)
Weight, g/mol:	311.070655
ΔH_f, kcal/mol:	-97.29
Dipole, Da:	10.89
IP(EA), eV:	-10.87(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxyethyl)-5-(2-methoxy-2-methylpropyl)-1,2,4-triazole-3-sulfonyl chloride

Drug info:

PubChemData

Smile

CC(C)(CC1=NC(=NN1)S(=O)(=O)Cl)OC

DOS

IR

Vibrations